Exchange–Correlation Functional with Good Accuracy for Both...

Exchange–Correlation Functional with Good Accuracy for Both Structural and Energetic Properties while Depending Only on the Density and Its Gradient

Peverati, Roberto, Truhlar, Donald G.
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Volume:
8
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct3002656
Date:
July, 2012
File:
PDF, 681 KB
english, 2012
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